CN1C(=C(C=N1)C=O)C2=CC=C(C=C2)F
CAS: 689250-52-0
Nombre: 5-(4-fluorophenyl)-1-methylpyrazole-4-carbaldehyde
SMILES: CN1C(=C(C=N1)C=O)C2=CC=C(C=C2)F

Molecular Processing

Molecular formula
C11H9FN2O
Molecular weight
204.2
Exact mass
204.0699
XLogP
2.04
TPSA
34.89
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.091
Molar refractivity
53.99

Supplementary Information

InChIKey: KDOBULPPDRXTKE-UHFFFAOYSA-N
Sinónimos
5-(4-fluorophenyl)-1-methyl-1H-pyrazole-4-carbaldehyde689250-52-05-(4-fluorophenyl)-1-methylpyrazole-4-carbaldehydeSCHEMBL3630473SBB027228STK695703AKOS000447014DB-107117ST4148446A1-22800
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